ホームMCPワークベンチSkills
ホームワークベンチ通知マイページ
llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.8.0
  1. ホーム
  2. /反応

Pyridine → Sodium 2-((1E,3Z,5E)-3-Bromo-5-(1,1-dimethyl-6,8-disulfonato-3-(3-sulfonatopropyl)-1H-benzo[e]indol-2(3H)-ylidene)penta-1,3-dienyl)-1,1-dimethyl-3-(3-sulfonatopropyl)-1H-benzo[e]indolium-6,8-disulfonate

HRID 449534
ノート
印刷プレビュー

反応式

HRID 449534 の反応式
[CH3:1][C:2]1([CH3:31])[C:10]2[C:9]3[CH:11]=[C:12]([S:19]([O-:22])(=[O:21])=[O:20])[CH:13]=[C:14]([S:15]([O-:18])(=[O:17])=[O:16])[C:8]=3[CH:7]=[CH:6][C:5]=2[N+:4]([CH2:23][CH2:24][CH2:25][S:26]([O-:29])(=[O:28])=[O:27])=[C:3]1[CH3:30].[Na+:32].[Na+].[Br-:34].Br/[C:36](=[CH:45]\[NH:46][C:47]1[CH:52]=[CH:51][CH:50]=[CH:49][CH:48]=1)/[CH:37]=[NH+]/C1C=CC=CC=1.N1[CH:58]=[CH:57][CH:56]=[CH:55][CH:54]=1.C(O[C:63](=O)[CH3:64])(=O)C>C(OCC)C>[Br:34]/[C:55](=[CH:56]\[CH:57]=[C:58]1\[N:46]([CH2:45][CH2:36][CH2:37][S:19]([O-:22])(=[O:21])=[O:20])[C:47]2[CH:48]=[CH:49][C:50]3[C:64]([S:26]([O-:29])(=[O:28])=[O:27])=[CH:63][C:14]([S:15]([O-:18])(=[O:17])=[O:16])=[CH:13][C:51]=3[C:52]=2[C:2]\1([CH3:3])[CH3:1])/[CH:54]=[CH:30]/[C:3]1[C:2]([CH3:31])([CH3:1])[C:10]2[C:9]3[CH:11]=[C:12]([S:19]([O-:22])(=[O:20])=[O:21])[CH:13]=[C:14]([S:15]([O-:18])(=[O:16])=[O:17])[C:8]=3[CH:7]=[CH:6][C:5]=2[N+:4]=1[CH2:23][CH2:24][CH2:25][S:26]([O-:29])(=[O:28])=[O:27].[Na+:32].[Na+:32].[Na+:32].[Na+:32].[Na+:32]
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

6

反応物 4

HCID 1049PyridineHCID 7918Acetic AnhydrideHCID 86649205Sodium 1,1,2-Trimethyl-3-(3-sulfonatopropyl)-1H-benzo[e]indolium-6,8-disulfonateHCID 178419561HCID 178419561、化合物

生成物 1

HCID 86649203
Sodium 2-((1E,3Z,5E)-3-Bromo-5-(1,1-dimethyl-6,8-disulfonato-3-(3-sulfonatopropyl)-1H-benzo[e]indol-2(3H)-ylidene)penta-1,3-dienyl)-1,1-dimethyl-3-(3-sulfonatopropyl)-1H-benzo[e]indolium-6,8-disulfonate
収率 50%

試薬・触媒・溶媒 1

HCID 3283Diethyl Ether溶媒

反応条件

温度
115 °C

実験手順

A 100 ml round bottom flask fitted with a reflux condenser was charged with sodium 1,1,2-trimethyl-3-(3-sulfonatopropyl)-1H-benzo[e]indolium-6,8-disulfonate (3) (565 mg, 1 mmol), (E)-N—((Z)-2-bromo-3-(phenylamino)allylidene)benzenaminium bromide (5) (150 mg, 0.5 mmol), and pyridine (1 ml). Acetic anhydride (10 ml) was added to the flask, and the mixture was heated at 115° C. for 2 h, cooled to room temperature, and diluted with 25 ml of ethyl ether. The resulting dark blue dye precipitate was collected by filtration, then dissolved in 20 ml of water and purified by preparative reverse-phase HPLC to afford the compound 6 as a blue powder (285 mg, 50%; UV/vis absorption max 674 nm).

後処理

  1. customA 100 ml round bottom flask fitted with a reflux condenser
  2. temperaturecooled to room temperature
  3. filtrationThe resulting dark blue dye precipitate was collected by filtration
  4. dissolutiondissolved in 20 ml of water
  5. custompurified by preparative reverse-phase HPLC

出典と根拠

ORDレコード
ord-28399a89bfa94eb69d49f288c02095d6
出典データセット
uspto-grants-2013_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08481752B2

反応ノート

読み込み中…

このページの内容参加物反応条件実験手順後処理出典と根拠反応ノート